Comparing 3D Pharmacophore Triplets and 2D Fingerprints for Selecting Diverse Compound Subsets
作者： Hans Matter , Thorsten Pötter
DOI: 10.1021/CI980185H
关键词:
摘要: … coefficients for every structure to its nearest neighbor. For all PDT and combined 2D/3D descriptor-based dissimilarity selections, the same seed compound as that for 2D fingerprints is …
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sci-hub.se 参考文章(29)
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